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Volumn 116, Issue 8, 2002, Pages 3194-3203

Perturbative corrections to the equation-of-motion spin-flip self-consistent field model: Application to bond-breaking and equilibrium properties of diradicals

(2) Krylov, Anna I a David Sherrill, C b

a UNIVERSITY OF SOUTHERN CALIFORNIA (United States)

b GEORGIA INSTITUTE OF TECHNOLOGY (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CORRELATION METHODS; EQUATIONS OF MOTION; ERROR CORRECTION; ETHYLENE; FREE RADICALS; HYDROGEN; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; PERTURBATION TECHNIQUES;

SPIN-FLIP SELF-CONSISTENT FIELD (SF-SCF) WAVE FUNCTIONS;

CHEMICAL BONDS;

EID: 0037154550 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1445116 Document Type: Article

Times cited : (199)

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